N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-4-[(2-nitrophenyl)amino]butanamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-4-[(2-nitrophenyl)amino]butanamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-4-(2-nitroanilino)butanamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-4-(2-nitroanilino)butanamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-4-(2-nitroanilino)butanamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-4-(2-nitroanilino)butyramide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)CCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)CCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O5/c1-15(2)22(16-9-10-19-20(14-16)30-13-12-29-19)24-21(26)8-5-11-23-17-6-3-4-7-18(17)25(27)28/h3-4,6-7,9-10,14-15,22-23H,5,8,11-13H2,1-2H3,(H,24,26)